N-[2,6-bis(ethylsulfanyl)phenyl]-N-[(3-chlorophenyl)-pyridin-2-yl-methyl]-2-iodanyl-4-propyl-benzenesulfonamide

Systemtic Name: N-[2,6-bis(ethylsulfanyl)phenyl]-N-[(3-chlorophenyl)-pyridin-2-yl-methyl]-2-iodanyl-4-propyl-benzenesulfonamide Openeye Name: N-[2,6-bis(ethylsulfanyl)phenyl]-N-[(3-chlorophenyl)-(2-pyridyl)methyl]-2-iodo-4-propyl-benzenesulfonamide CAS Name: N-[2,6-bis(ethylthio)phenyl]-N-[(3-chlorophenyl)-(2-pyridinyl)methyl]-2-iodo-4-propylbenzenesulfonamide IUPAC Name: N-[2,6-bis(ethylsulfanyl)phenyl]-N-[(3-chlorophenyl)-pyridin-2-ylmethyl]-2-iodo-4-propylbenzenesulfonamide Traditional Name: N-[2,6-bis(ethylthio)phenyl]-N-[(3-chlorophenyl)-(2-pyridyl)methyl]-2-iodo-4-propyl-benzenesulfonamide Formula: C31H32ClIN2O2S3 MolecularWeight: 723.15045

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CCCC1=CC(=C(C=C1)S(=O)(=O)N(C2=C(C=CC=C2SCC)SCC)C(C3=CC(=CC=C3)Cl)C4=CC=CC=N4)I

Isomeric SMILES

CCCC1=CC(=C(C=C1)S(=O)(=O)N(C2=C(C=CC=C2SCC)SCC)C(C3=CC(=CC=C3)Cl)C4=CC=CC=N4)I

InChI

InChI=1S/C31H32ClIN2O2S3/c1-4-11-22-17-18-29(25(33)20-22)40(36,37)35(31-27(38-5-2)15-10-16-28(31)39-6-3)30(26-14-7-8-19-34-26)23-12-9-13-24(32)21-23/h7-10,12-21,30H,4-6,11H2,1-3H3